[4-[3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl] benzoate

Systemtic Name: [4-[3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]carbonyl-1-benzothiophen-2-yl]phenyl] benzoate Openeye Name: [4-[3-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]benzothiophen-2-yl]phenyl] benzoate CAS Name: benzoic acid [4-[3-[oxo-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methyl]-1-benzothiophen-2-yl]phenyl] ester IUPAC Name: [4-[3-[4-(2-pyrrolidin-1-ylethoxy)benzoyl]-1-benzothiophen-2-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[3-[4-(2-pyrrolidinoethoxy)benzoyl]benzothiophen-2-yl]phenyl] ester Formula: C34H29NO4S MolecularWeight: 547.66336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=CC=CC=C43)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=CC=CC=C43)C5=CC=C(C=C5)OC(=O)C6=CC=CC=C6

InChI

InChI=1S/C34H29NO4S/c36-32(24-12-16-27(17-13-24)38-23-22-35-20-6-7-21-35)31-29-10-4-5-11-30(29)40-33(31)25-14-18-28(19-15-25)39-34(37)26-8-2-1-3-9-26/h1-5,8-19H,6-7,20-23H2